12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole

C37H26N2 — CID 121287125

IUPAC12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole
SMILESCc1ccc(-n2c3ccc(-c4ccccc4)cc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)cc1
InChIInChI=1S/C37H26N2/c1-25-16-19-29(20-17-25)39-34-22-18-27(26-10-4-2-5-11-26)24-32(34)30-21-23-35-36(37(30)39)31-14-8-9-15-33(31)38(35)28-12-6-3-7-13-28/h2-24H,1H3
InChIKeyHKSXQAMMABIBFA-UHFFFAOYSA-N
MW498.63 g/mol
LogP9.86
Rot. Bonds3

About 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole

12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole (PubChem CID 121287125) has the molecular formula C37H26N2 and a molecular weight of 498.63 g/mol. Its IUPAC name is 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole
PubChem CID121287125
Molecular FormulaC37H26N2
Molecular Weight498.63 g/mol
Exact Mass498.21
IUPAC Name12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole
SMILESCc1ccc(-n2c3ccc(-c4ccccc4)cc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)cc1
InChIInChI=1S/C37H26N2/c1-25-16-19-29(20-17-25)39-34-22-18-27(26-10-4-2-5-11-26)24-32(34)30-21-23-35-36(37(30)39)31-14-8-9-15-33(31)38(35)28-12-6-3-7-13-28/h2-24H,1H3
InChIKeyHKSXQAMMABIBFA-UHFFFAOYSA-N
XLogP9.86
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500498.63
LogP ≤ 59.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-phenyl-12-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]indolo[3,2-c]carbazole
CID 134168773
12-[4-(3-carbazol-9-ylphenyl)phenyl]-5-phenylindolo[3,2-c]carbazole;12-[4-(9-phenylcarbazol-2-yl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(9-phenylcarbazol-3-yl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 159456602
12-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5,9-diphenylindolo[3,2-c]carbazole
CID 126628139
12-(3-phenylphenyl)-5-[4-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598833
12-[3-(4-carbazol-9-ylphenyl)phenyl]-5-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 134168746
5-(3-phenylphenyl)-12-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 126656172
12-(4-phenylphenyl)-5-(3-triphenylen-2-ylphenyl)indolo[3,2-c]carbazole
CID 170676015
3-carbazol-9-yl-9-[3-[3-(3-phenylphenyl)phenyl]phenyl]carbazole;12-(3,5-diphenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]carbazole;9-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 159378561
12-(4-carbazol-9-ylphenyl)-5-(3-phenylphenyl)indolo[3,2-c]carbazole
CID 134168741
5-(9-phenylcarbazol-2-yl)-12-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 134168829
12-(3,5-diphenylphenyl)-5-phenylindolo[3,2-c]carbazole;12-(3,5-diphenylphenyl)-5-(4-phenylphenyl)indolo[3,2-c]carbazole;12-[4-(3,5-diphenylphenyl)phenyl]-5-phenylindolo[3,2-c]carbazole
CID 167636301
5,12-bis[3-(4-phenylphenyl)phenyl]indolo[3,2-c]carbazole
CID 122598848

Frequently Asked Questions

What is the IUPAC name of 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole?
The IUPAC name of 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole (CID 121287125) is 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole.
What is the SMILES notation for 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole?
The canonical SMILES for 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole is Cc1ccc(-n2c3ccc(-c4ccccc4)cc3c3ccc4c(c5ccccc5n4-c4ccccc4)c32)cc1.
What is the InChIKey of 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole?
The InChIKey is HKSXQAMMABIBFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26N2/c1-25-16-19-29(20-17-25)39-34-22-18-27(26-10-4-2-5-11-26)24-32(34)30-21-23-35-36(37(30)39)31-14-8-9-15-33(31)38(35)28-12-6-3-7-13-28/h2-24H,1H3.
What are the key properties of 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole?
12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole has a molecular weight of 498.63 g/mol, XLogP of 9.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 12-(4-methylphenyl)-5,9-diphenylindolo[3,2-c]carbazole is sourced from PubChem (CID 121287125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).